N-(4-methoxyphenyl)-4-quinazolin-2-yl-1,3-oxazol-2-amine

C18H14N4O2 — CID 145386275

IUPACN-(4-methoxyphenyl)-4-quinazolin-2-yl-1,3-oxazol-2-amine
SMILESCOc1ccc(Nc2nc(-c3ncc4ccccc4n3)co2)cc1
InChIInChI=1S/C18H14N4O2/c1-23-14-8-6-13(7-9-14)20-18-22-16(11-24-18)17-19-10-12-4-2-3-5-15(12)21-17/h2-11H,1H3,(H,20,22)
InChIKeyJEAOVCJYZJPIMV-UHFFFAOYSA-N
MW318.34 g/mol
LogP4.04
Rot. Bonds4

About N-(4-methoxyphenyl)-4-quinazolin-2-yl-1,3-oxazol-2-amine

N-(4-methoxyphenyl)-4-quinazolin-2-yl-1,3-oxazol-2-amine (PubChem CID 145386275) has the molecular formula C18H14N4O2 and a molecular weight of 318.34 g/mol. Its IUPAC name is N-(4-methoxyphenyl)-4-quinazolin-2-yl-1,3-oxazol-2-amine.

Molecular Properties

Compound NameN-(4-methoxyphenyl)-4-quinazolin-2-yl-1,3-oxazol-2-amine
PubChem CID145386275
Molecular FormulaC18H14N4O2
Molecular Weight318.34 g/mol
Exact Mass318.11
IUPAC NameN-(4-methoxyphenyl)-4-quinazolin-2-yl-1,3-oxazol-2-amine
SMILESCOc1ccc(Nc2nc(-c3ncc4ccccc4n3)co2)cc1
InChIInChI=1S/C18H14N4O2/c1-23-14-8-6-13(7-9-14)20-18-22-16(11-24-18)17-19-10-12-4-2-3-5-15(12)21-17/h2-11H,1H3,(H,20,22)
InChIKeyJEAOVCJYZJPIMV-UHFFFAOYSA-N
XLogP4.04
TPSA73.07 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.34
LogP ≤ 54.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-(4-methoxyphenyl)-4-quinazolin-2-yl-1,3-oxazol-2-amine?
The IUPAC name of N-(4-methoxyphenyl)-4-quinazolin-2-yl-1,3-oxazol-2-amine (CID 145386275) is N-(4-methoxyphenyl)-4-quinazolin-2-yl-1,3-oxazol-2-amine.
What is the SMILES notation for N-(4-methoxyphenyl)-4-quinazolin-2-yl-1,3-oxazol-2-amine?
The canonical SMILES for N-(4-methoxyphenyl)-4-quinazolin-2-yl-1,3-oxazol-2-amine is COc1ccc(Nc2nc(-c3ncc4ccccc4n3)co2)cc1.
What is the InChIKey of N-(4-methoxyphenyl)-4-quinazolin-2-yl-1,3-oxazol-2-amine?
The InChIKey is JEAOVCJYZJPIMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14N4O2/c1-23-14-8-6-13(7-9-14)20-18-22-16(11-24-18)17-19-10-12-4-2-3-5-15(12)21-17/h2-11H,1H3,(H,20,22).
What are the key properties of N-(4-methoxyphenyl)-4-quinazolin-2-yl-1,3-oxazol-2-amine?
N-(4-methoxyphenyl)-4-quinazolin-2-yl-1,3-oxazol-2-amine has a molecular weight of 318.34 g/mol, XLogP of 4.04, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methoxyphenyl)-4-quinazolin-2-yl-1,3-oxazol-2-amine is sourced from PubChem (CID 145386275), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).